8019-5539 Screening compound: 5-(tert-butyl)-N~1~-(3,4-dimethoxyphenethyl)-2-methoxy-1-benzenesulfonamide

8019-5539 Screening compound: 5-(tert-butyl)-N~1~-(3,4-dimethoxyphenethyl)-2-methoxy-1-benzenesulfonamide
8019-5539 Screening compound: 5-(tert-butyl)-N~1~-(3,4-dimethoxyphenethyl)-2-methoxy-1-benzenesulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8019-5539
5-(tert-butyl)-N~1~-(3,4-dimethoxyphenethyl)-2-methoxy-1-benzenesulfonamide

Available from 1 mg

Formats:

  • Glass Vials (4ml Glass Vials VWR #97047-678)
  • 96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)

Shiptime: 1 week worldwide delivery in most cases

Compound Identifiers

ChemDiv Compound ID

8019-5539

Molecular Formula

C21H29NO5S (C21 H29 NO5 S)

Compound Name

5-(tert-butyl)-N~1~-(3,4-dimethoxyphenethyl)-2-methoxy-1-benzenesulfonamide

IUPAC name

n/a

SMILES

CC(C)(C)c(cc1)cc(S(NCCc(cc2)cc(OC)c2OC)(=O)=O)c1OC

InChI

InChI=1S/C21H29NO5S/c1-21(2,3)16-8-10-18(26-5)20(14-16)28(23,24)22-12-11-15-7-9-17(25-4)19(13-15)27-6/h7-10,13-14,22H,11-12H2,1-6H3

InChI Key

FVJVOUMOVXFIRL-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

407.53

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.036

Distribution Coefficient, logD

4.036

Water Solubility, LogSw

-4.18

Polar Surface Area

64.729

Acid Dissociation Constant (pKa)

11.65

Base Dissociation Constant (pKb)

-3.04

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

42.90

References: we are preparing a list of scientific research reports with 8019-5539 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8019-5539?
Check Price and Availability of 8019-5539, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of 8019-5539 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8019-5539
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8019-5539
  • 0.5–50 mg of dry powder sample in single glass vials, custom vials
  • DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)

Custom synthesis of 8019-5539 available by request